[1-[(2-methoxyphenyl)amino]isoquinolin-4-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [1-[(2-methoxyphenyl)amino]isoquinolin-4-yl]-pyrrolidin-1-yl-methanone Openeye Name: [1-(2-methoxyanilino)-4-isoquinolyl]-pyrrolidin-1-yl-methanone CAS Name: [1-(2-methoxyanilino)-4-isoquinolinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [1-(2-methoxyanilino)isoquinolin-4-yl]-pyrrolidin-1-ylmethanone Traditional Name: [1-(o-anisidino)-4-isoquinolyl]-pyrrolidino-methanone Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC2=NC=C(C3=CC=CC=C32)C(=O)N4CCCC4

Isomeric SMILES

COC1=CC=CC=C1NC2=NC=C(C3=CC=CC=C32)C(=O)N4CCCC4

InChI

InChI=1S/C21H21N3O2/c1-26-19-11-5-4-10-18(19)23-20-16-9-3-2-8-15(16)17(14-22-20)21(25)24-12-6-7-13-24/h2-5,8-11,14H,6-7,12-13H2,1H3,(H,22,23)